CHEMBL1090811


SMILES Cn1cc2c(nc(N)n3nc(-c4ccc(Br)cc4)nc23)n1
InChIKey MMSBEDKQYXATNO-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 1
Molecular weight (Da) 343.0

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
A3 AA3R Human Adenosine A pKi 7.41 7.41 7.41 ChEMBL
A2A AA2AR Human Adenosine A pKi 5.82 5.82 5.82 ChEMBL
A1 AA1R Human Adenosine A pKi 5.54 5.54 5.54 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database